Bicarbonate

Bicarbonate

SCHEMBL2872040

CC1(C)OB(c2cnc(C(N)=O)nc2)OC1(C)C.O=C(O)O.O=C(O)O

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GSK3AGSK3BIMPA1

The experimentally established mechanism targets of Bicarbonate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3A known ✓ P49840 1/20 0.38
GSK3B known ✓ P49841 1/20 0.38
PDGFRB P09619 3/20 0.42
KDR P35968 3/20 0.42
F11 P03951 4/20 0.42
F2 P00734 3/20 0.42
PRSS1 P07477 2/20 0.42
PRSS2 P07478 2/20 0.42
PRSS3 P35030 2/20 0.42
DGAT1 O75907 2/20 0.40
ROCK2 O75116 1/20 0.40
LIPG Q9Y5X9 2/20 0.38
LPL P06858 1/20 0.38
P4HB P07237 1/20 0.37
FFAR1 O14842 1/20 0.36
CA1 P00915 3/20 0.36
CA2 P00918 3/20 0.36
CA9 Q16790 3/20 0.36
CA12 O43570 1/20 0.36
CA3 P07451 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Carbamic Acid SCHEMBL3411507 0.80 F11 (0.43) PDGFRBKDRF11F2PRSS1
Bicarbonate SCHEMBL364588 0.78 DGAT1 (0.42) PDGFRBKDRF11F2PRSS1
Bicarbonate SCHEMBL13674697 0.78 F2 (0.33) PDGFRBKDRF11F2PRSS1
SCHEMBL15720308 0.77 DGAT1 (0.49) PDGFRBKDRDGAT1ROCK2LIPG
Carbamic Acid SCHEMBL17997310 0.77 PDGFRB (0.45) PDGFRBKDRF11F2PRSS1
SCHEMBL2068378 0.76 DGAT1 (0.48) PDGFRBKDRF11F2PRSS1
SCHEMBL2872042 0.75 PDGFRB (0.43) PDGFRBKDRF11F2PRSS1
SCHEMBL17799957 0.74 PDGFRB (0.44) PDGFRBKDRF11F2PRSS1
SCHEMBL2730557 0.74 DGAT1 (0.40) PDGFRBKDRF11F2PRSS1
SCHEMBL19506242 0.74 PDGFRB (0.42) PDGFRBKDRF11F2PRSS1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2336132-B1 MORPHOLINOPURINE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2014-01-01 EP disclosed
US-8309546-B2 Morpholinopurine derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-11-13 US disclosed
US-20100130492-A1 MORPHOLINOPURINE DERIVATIVES DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-05-27 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100130492-A1 MORPHOLINOPURINE DERIVATIVES MTOR, RICTOR, PIK3R1 GSK3A 401/4885GSK3B 264/4885PDGFRB 2943/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.